IBS-ZINC05093508 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 1.7250 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 1.3500 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 1.7910 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.1540 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -0.0980 3.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -0.7060 4.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1750 -0.7680 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 -2.0990 4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -2.2230 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -1.0910 3.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -3.4380 4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -3.5510 4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -4.7980 4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -5.6980 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -4.9740 5.1950 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 0.1580 5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4900 -0.3430 5.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 0.4330 6.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7640 1.7200 6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 2.2230 6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 1.4390 5.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 1.9670 4.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 3.4900 6.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 4.2380 7.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.3770 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.0060 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.3590 4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.8090 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 1.4730 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 2.8770 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.0690 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 1.4860 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -2.1600 5.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -2.8680 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -2.7320 4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -5.0300 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -6.7190 5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 -1.3470 5.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 0.0360 7.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 2.3320 7.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 4.3360 7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 3.7210 8.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 5.2290 7.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END